- InChI
- InChI=1S/C14H22/c1-9(2)13-7-10(3)8-14-11(4)5-6-12(13)14/h10-11H,5-8H2,1-4H3/t10-,11+/m1/s1
- InChI Key
- QAXOTPHOTITIST-MNOVXSKESA-N
- Formula
- C14H22
- SMILES
- CC(C)=C1CC(C)CC2=C1CCC2C
- Molecular Weight1
- 190.32
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | 199.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -104.09 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.58 | kJ/mol | Joback Calculated Property |
| log10WS | -4.70 | Crippen Calculated Property | |
| logPoct/wat | 4.479 | Crippen Calculated Property | |
| McVol | 177.800 | ml/mol | McGowan Calculated Property |
| Pc | 2090.75 | kPa | Joback Calculated Property |
| I | 1529.00 | NIST | |
| Tboil | 561.65 | K | Joback Calculated Property |
| Tc | 777.37 | K | Joback Calculated Property |
| Tfus | 295.06 | K | Joback Calculated Property |
| Vc | 0.679 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [449.72; 557.37] | J/mol×K | [561.65; 777.37] | 
|
| Cp,gas | 449.72 | J/mol×K | 561.65 | Joback Calculated Property |
| Cp,gas | 470.47 | J/mol×K | 597.60 | Joback Calculated Property |
| Cp,gas | 490.01 | J/mol×K | 633.56 | Joback Calculated Property |
| Cp,gas | 508.41 | J/mol×K | 669.51 | Joback Calculated Property |
| Cp,gas | 525.73 | J/mol×K | 705.47 | Joback Calculated Property |
| Cp,gas | 542.03 | J/mol×K | 741.42 | Joback Calculated Property |
| Cp,gas | 557.37 | J/mol×K | 777.37 | Joback Calculated Property |
Similar Compounds
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Sources
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